cyclohexyl 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoate

Systemtic Name: cyclohexyl 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoate Openeye Name: cyclohexyl 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoate CAS Name: 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoic acid cyclohexyl ester IUPAC Name: cyclohexyl 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoate Traditional Name: 4-[[4-(2-phenylethynyl)phenoxy]methoxy]benzoic acid cyclohexyl ester Formula: C28H26O4 MolecularWeight: 426.50364

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)OCOC3=CC=C(C=C3)C#CC4=CC=CC=C4

Isomeric SMILES

C1CCC(CC1)OC(=O)C2=CC=C(C=C2)OCOC3=CC=C(C=C3)C#CC4=CC=CC=C4

InChI

InChI=1S/C28H26O4/c29-28(32-27-9-5-2-6-10-27)24-15-19-26(20-16-24)31-21-30-25-17-13-23(14-18-25)12-11-22-7-3-1-4-8-22/h1,3-4,7-8,13-20,27H,2,5-6,9-10,21H2